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Commit 57f6b9c8 authored by Marcin Kirsz's avatar Marcin Kirsz
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Update

parent f2635fe1
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Pipeline #42904 passed
Pipeline: Tadah.MLIP

#42907

    ......@@ -28,16 +28,14 @@ class Trainer {
    dc(config,*DCS.d2b,*DCS.d3b,*DCS.dmb,
    *DCS.c2b,*DCS.c3b,*DCS.cmb),
    nnf(config),
    fb(CONFIG::factory<DM_Function_Base,Config&>(
    config.get<std::string>("MODEL",1),config)),
    model(CONFIG::factory<M_Tadah_Base,DM_Function_Base&,Config&>
    (config.get<std::string>("MODEL",0),*fb,config)),
    dm(*fb, config)
    {
    config.postprocess();
    config.check_for_training();
    fb = CONFIG::factory<DM_Function_Base,Config&>(
    config.get<std::string>("MODEL",1),config);
    model = CONFIG::factory<M_Tadah_Base,DM_Function_Base&,Config&>
    (config.get<std::string>("MODEL",0),*fb,config);
    }
    Trainer (std::string &c_file):
    config(c_file),
    ......@@ -47,16 +45,12 @@ class Trainer {
    nnf(config),
    fb(CONFIG::factory<DM_Function_Base,Config&>(
    config.get<std::string>("MODEL",1),config)),
    model(CONFIG::factory<M_Tadah_Base,DM_Function_Base&,Config&>
    (config.get<std::string>("MODEL",0),*fb,config)),
    dm(*fb, config)
    {
    config.postprocess();
    config.check_for_training();
    //fb = CONFIG::factory<DM_Function_Base,Config&>(
    // config.get<std::string>("MODEL",1),config);
    model = CONFIG::factory<M_Tadah_Base,DM_Function_Base&,Config&>
    (config.get<std::string>("MODEL",0),*fb,config);
    }
    void train(StructureDB &stdb) {
    ......
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